SCHEMBL11265313

SCHEMBL11265313

COC(=O)C(C(C)=O)C(C(=O)c1cccs1)c1cccc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
GAA P10253 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KCNMA1 Q12791 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11266686 0.87 KMT2A (0.50) HPGDNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL11261799 0.82 SMN1; SMN2 (0.49) HPGDNPC1RAB9ASMN1; SMN2POLB
SCHEMBL11260852 0.80 OPRM1 (0.46) HPGDL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL7056919 0.79 SMN1; SMN2 (0.44) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL11263287 0.77 KMT2A (0.48) HPGDNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL11261892 0.77 CYP1A1 (0.40) L3MBTL1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL11270499 0.73 MEN1 (0.44) HPGDL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL11263124 0.73 KMT2A (0.38) HPGDNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL17291147 0.71 KMT2A (0.53) HPGDNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL661853 0.70 KMT2A (0.48) HPGDNPC1RAB9ASMN1; SMN2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4360520-A 1,4-Dihydropyridazine compounds, and their medicinal use BAYER AKTIENGESELLSCHAFT (DE) 1982-11-23 US disclosed